1,1-bis(fluoranyl)-2-(3-oxidanyl-1-adamantyl)ethanesulfonic acid

Systemtic Name: 1,1-bis(fluoranyl)-2-(3-oxidanyl-1-adamantyl)ethanesulfonic acid Openeye Name: 1,1-difluoro-2-(3-hydroxy-1-adamantyl)ethanesulfonic acid CAS Name: 1,1-difluoro-2-(3-hydroxy-1-adamantyl)ethanesulfonic acid IUPAC Name: 1,1-difluoro-2-(3-hydroxy-1-adamantyl)ethanesulfonic acid Traditional Name: 1,1-difluoro-2-(3-hydroxy-1-adamantyl)ethanesulfonic acid Formula: C12H18F2O4S MolecularWeight: 296.330726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)CC(F)(F)S(=O)(=O)O

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)CC(F)(F)S(=O)(=O)O

InChI

InChI=1S/C12H18F2O4S/c13-12(14,19(16,17)18)7-10-2-8-1-9(3-10)5-11(15,4-8)6-10/h8-9,15H,1-7H2,(H,16,17,18)